=============================================================================
          SHIFTS, version 4.1   [X.-P. Xu and D.A. Case, Mar. 2002]
=============================================================================
   shifts will be computed for atoms matching ::H*
found 19 rings
        ring        int.           center             anis.    iso.
       HIS  3     0.900     8.210  73.808  50.135  -99.200  -91.000
       PHE 11     1.000    -1.325  66.823  39.199  -99.200  -91.000
       PHE 14     1.000    -5.304  70.283  40.945  -99.200  -91.000
       HIS 24     0.900   -10.843  82.263  41.191  -99.200  -91.000
       TYR 36     0.840    17.164  77.391  31.894  -99.200  -91.000
       TYR 48     0.840     7.210  82.812  36.371  -99.200  -91.000
       TYR 51     0.840     5.615  78.352  33.573  -99.200  -91.000
       TRP 67     1.040    -5.473  90.506  42.412  -99.200  -91.000
      TRP6 67     1.020    -3.776  89.437  43.562  -99.200  -91.000
       PHE 71     1.000     6.278  91.359  48.781  -99.200  -91.000
       HIS 81     0.900    11.812  88.665  48.237  -99.200  -91.000
       TRP 82     1.040     5.599  85.521  48.460  -99.200  -91.000
      TRP6 82     1.020     6.556  83.399  48.319  -99.200  -91.000
       HIS 84     0.900     6.634  87.567  38.283  -99.200  -91.000
       PHE 86     1.000     0.423  83.930  38.517  -99.200  -91.000
       TYR 90     0.840    -5.651  77.078  35.174  -99.200  -91.000
       PHE 96     1.000    -3.213  73.207  37.264  -99.200  -91.000
       TYR 104     0.840     2.543  73.532  32.053  -99.200  -91.000
       HIS 110     0.900    12.374  77.695  29.205  -99.200  -91.000